COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.194   0.465  -0.699  1.00  0.00           C  
HETATM    2  C   UNL     1       2.707   0.334  -0.513  1.00  0.00           C  
HETATM    3  C   UNL     1       0.496  -0.786  -0.168  1.00  0.00           C  
HETATM    4  O   UNL     1       0.895   0.627  -2.087  1.00  0.00           O  
HETATM    5  O   UNL     1       0.960   1.506   1.472  1.00  0.00           O  
HETATM    6  O   UNL     1       3.511  -0.979   1.417  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.814   1.826  -0.136  1.00  0.00           C  
HETATM    8  C   UNL     1       2.521  -2.147  -0.729  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.539   0.578   0.376  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.676  -1.906   0.258  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.033   0.738   0.068  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.161  -1.723   0.358  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.758  -0.556   0.280  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.203   1.177  -1.388  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.223  -0.517   0.410  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.866   0.644   0.337  1.00  0.00           C  
HETATM   17  C   UNL     1       0.692   1.684   0.080  1.00  0.00           C  
HETATM   18  C   UNL     1       3.211  -0.894  -1.273  1.00  0.00           C  
HETATM   19  C   UNL     1       3.022   0.182   0.953  1.00  0.00           C  
HETATM   20  C   UNL     1       3.398   1.587  -1.055  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.019  -0.664  -0.358  1.00  0.00           C  
HETATM   22  C   UNL     1       1.002  -2.016  -0.924  1.00  0.00           C  
HETATM   23  C   UNL     1       0.809  -0.950   1.321  1.00  0.00           C  
HETATM   24  O   UNL     1       2.834   1.104   1.710  1.00  0.00           O  
HETATM   25  H   UNL     1       1.301   1.408  -2.488  1.00  0.00           H  
HETATM   26  H   UNL     1       0.668   2.243   2.026  1.00  0.00           H  
HETATM   27  H   UNL     1       3.698  -1.029   2.365  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.016   1.950  -1.200  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.174   2.701   0.405  1.00  0.00           H  
HETATM   30  H   UNL     1       2.881  -3.023  -1.269  1.00  0.00           H  
HETATM   31  H   UNL     1       2.746  -2.255   0.331  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.390   0.475   1.451  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.267  -2.072   1.254  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.463  -2.772  -0.368  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.456   1.498   0.724  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.773  -2.601   0.502  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.772   0.424  -2.048  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.263   1.292  -1.612  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.694   2.129  -1.542  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.776  -1.431   0.565  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.941   0.673   0.433  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.313   1.559   0.183  1.00  0.00           H  
HETATM   43  H   UNL     1       1.199   2.580  -0.278  1.00  0.00           H  
HETATM   44  H   UNL     1       2.986  -0.786  -2.334  1.00  0.00           H  
HETATM   45  H   UNL     1       4.289  -0.986  -1.138  1.00  0.00           H  
HETATM   46  H   UNL     1       3.039   2.463  -0.513  1.00  0.00           H  
HETATM   47  H   UNL     1       4.476   1.494  -0.923  1.00  0.00           H  
HETATM   48  H   UNL     1       3.170   1.698  -2.115  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.257  -0.605  -1.420  1.00  0.00           H  
HETATM   50  H   UNL     1       0.508  -2.908  -0.538  1.00  0.00           H  
HETATM   51  H   UNL     1       0.780  -1.909  -1.986  1.00  0.00           H  
HETATM   52  H   UNL     1       0.556  -0.030   1.849  1.00  0.00           H  
HETATM   53  H   UNL     1       0.224  -1.774   1.727  1.00  0.00           H  
HETATM   54  H   UNL     1       1.871  -1.161   1.448  1.00  0.00           H  
CONECT    1    2    3    4   17                                       
CONECT    2   18   19   20    1                                       
CONECT    3   22   23    1   21                                       
CONECT    4    1   25                                                 
CONECT    5   17   26                                                 
CONECT    6   19   27                                                 
CONECT    7   17    9   28   29                                       
CONECT    8   18   22   30   31                                       
CONECT    9   21    7   11   32                                       
CONECT   10   21   12   33   34                                       
CONECT   11    9   13   14   35                                       
CONECT   12   10   13   13   36                                       
CONECT   13   12   12   11   15                                       
CONECT   14   11   37   38   39                                       
CONECT   15   13   16   16   40                                       
CONECT   16   15   15   41   42                                       
CONECT   17    1    5    7   43                                       
CONECT   18    8    2   44   45                                       
CONECT   19   24   24    2    6                                       
CONECT   20    2   46   47   48                                       
CONECT   21    3   10    9   49                                       
CONECT   22    8    3   50   51                                       
CONECT   23    3   52   53   54                                       
CONECT   24   19   19                                                 
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
